SMILES:
Cc1c[nH]c2ncnc(Cl)c12Molecular Processing
Molecular formula
C7H6ClN3
Molecular weight
167.6
Exact mass
167.025
XLogP
1.92
TPSA
41.57
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
43.64
Supplementary Information
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